SCHEMBL7496402

SCHEMBL7496402

CC(=O)Oc1ccccc1-c1c(OC(C)=O)oc2ccccc2c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.48
ALDH1A1 P00352 5/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
CYP3A4 P08684 3/20 0.48
HSD17B10 Q99714 3/20 0.48
HPGD P15428 2/20 0.48
FPR1 P21462 5/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 3/20 0.46
MAOB P27338 1/20 0.46
HTT P42858 1/20 0.46
CASP3 P42574 1/20 0.45
CYP2C9 P11712 3/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
NTRK1 P04629 1/20 0.44
PLK3 Q9H4B4 1/20 0.44
MAOA P21397 3/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29036841 0.83 KDM4E (0.56) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL27994815 0.79 KDM4E (0.61) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL22445080 0.77 MAOA (0.68) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL896578 0.77 KDM4E (0.63) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL4849595 0.76 MAOA (0.68) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL12095236 0.76 NMUR2 (0.49) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL5773649 0.76 MAOB (0.49) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL19920964 0.75 ALDH1A1 (0.61) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL7496403 0.75 ADORA3 (0.51) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL8676653 0.72 PTGS2 (0.61) KDM4EALDH1A1MEN1KMT2AHSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1153020-A4 PRODUCTION OF ISOFLAVONE DERIVATIVES NOVOGEN RES PTY LTD (AU) 2002-08-21 EP claimed
EP-1153020-A1 PRODUCTION OF ISOFLAVONE DERIVATIVES Novogen Research Pty. Ltd. (AU) 2001-11-14 EP claimed
WO-2000049009-A1 PRODUCTION OF ISOFLAVONE DERIVATIVES NOVOGEN RESEARCH PTY. LTD. (AU) 2000-08-24 WO claimed